N-[4-(3-cyanophenyl)-5-(1,2,4-triazol-1-yl)-1,3-thiazol-2-yl]-3-methoxy-benzamide

Systemtic Name: N-[4-(3-cyanophenyl)-5-(1,2,4-triazol-1-yl)-1,3-thiazol-2-yl]-3-methoxy-benzamide Openeye Name: N-[4-(3-cyanophenyl)-5-(1,2,4-triazol-1-yl)thiazol-2-yl]-3-methoxy-benzamide CAS Name: N-[4-(3-cyanophenyl)-5-(1,2,4-triazol-1-yl)-2-thiazolyl]-3-methoxybenzamide IUPAC Name: N-[4-(3-cyanophenyl)-5-(1,2,4-triazol-1-yl)-1,3-thiazol-2-yl]-3-methoxybenzamide Traditional Name: N-[4-(3-cyanophenyl)-5-(1,2,4-triazol-1-yl)thiazol-2-yl]-3-methoxy-benzamide Formula: C20H14N6O2S MolecularWeight: 402.42916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=NC(=C(S2)N3C=NC=N3)C4=CC=CC(=C4)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=NC(=C(S2)N3C=NC=N3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H14N6O2S/c1-28-16-7-3-6-15(9-16)18(27)25-20-24-17(14-5-2-4-13(8-14)10-21)19(29-20)26-12-22-11-23-26/h2-9,11-12H,1H3,(H,24,25,27)